Vitas-M small molecule compound

1-{3-(4-fluorophenyl)-1-hydroxy-11-[4-(pentyloxy)phenyl]-2,3,4,11-tetrahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl}ethanone

Catalog ID
STL043842
SMILES CCCCCOc1ccc(cc1)C1C2=C(O)CC(CC2=Nc2c(N1C(=O)C)cccc2)c1ccc(cc1)F

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C32H33FN2O3 MW 512.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H33FN2O3/c1-3-4-7-18-38-26-16-12-23(13-17-26)32-31-28(34-27-8-5-6-9-29(27)35(32)21(2)36)19-24(20-30(31)37)22-10-14-25(33)15-11-22/h5-6,8-17,24,32,37H,3-4,7,18-20H2,1-2H3
InChIKey
MWZKGCGIPGSIHS-UHFFFAOYSA-N
Synonyms

1(3(4fluorophenyl)1hydroxy11(4(pentyloxy)phenyl)23411tetrahydro10Hdibenzo(be)(14)diazepin10yl)ethanone
MFCD04076876
ZINC000102873831
ZINC000102873840

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.